Geometric structures and hydrogen storage properties of M2B7 (M=Be, Mg, Ca) clusters
Hai‐Ru Li, Ceng Zhang, Wan-Biao Ren, Ying‐Jin Wang, Tao Han
Topics & Concepts
Hydrogen storagePhysisorptionDelocalized electronChemisorptionHydrogenAdsorptionDensity functional theoryMoleculeChemistryChemical physicsMaterials scienceAtomic physicsPhysical chemistryComputational chemistryPhysicsOrganic chemistryHydrogen Storage and MaterialsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials